2-(5-azanyl-2-propoxy-phenyl)purin-6-one

Systemtic Name: 2-(5-azanyl-2-propoxy-phenyl)purin-6-one Openeye Name: 2-(5-amino-2-propoxy-phenyl)purin-6-one CAS Name: 2-(5-amino-2-propoxyphenyl)-6-purinone IUPAC Name: 2-(5-amino-2-propoxyphenyl)purin-6-one Traditional Name: 2-(5-amino-2-propoxy-phenyl)purin-6-one Formula: C14H13N5O2 MolecularWeight: 283.28532

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)N)C2=NC(=O)C3=NC=NC3=N2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)N)C2=NC(=O)C3=NC=NC3=N2

InChI

InChI=1S/C14H13N5O2/c1-2-5-21-10-4-3-8(15)6-9(10)12-18-13-11(14(20)19-12)16-7-17-13/h3-4,6-7H,2,5,15H2,1H3